2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide

C10H16N6O4 — CID 23557818

IUPAC2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide
SMILESNNC(=O)CN(CCN1C(=O)C=CC1=O)CC(=O)NN
InChIInChI=1S/C10H16N6O4/c11-13-7(17)5-15(6-8(18)14-12)3-4-16-9(19)1-2-10(16)20/h1-2H,3-6,11-12H2,(H,13,17)(H,14,18)
InChIKeyRZEDTJVBKIPRPV-UHFFFAOYSA-N
MW284.28 g/mol
LogP-3.81
Rot. Bonds7

About 2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide

2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide (PubChem CID 23557818) has the molecular formula C10H16N6O4 and a molecular weight of 284.28 g/mol. Its IUPAC name is 2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide.

Molecular Properties

Compound Name2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide
PubChem CID23557818
Molecular FormulaC10H16N6O4
Molecular Weight284.28 g/mol
Exact Mass284.12
IUPAC Name2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide
SMILESNNC(=O)CN(CCN1C(=O)C=CC1=O)CC(=O)NN
InChIInChI=1S/C10H16N6O4/c11-13-7(17)5-15(6-8(18)14-12)3-4-16-9(19)1-2-10(16)20/h1-2H,3-6,11-12H2,(H,13,17)(H,14,18)
InChIKeyRZEDTJVBKIPRPV-UHFFFAOYSA-N
XLogP-3.81
TPSA150.86 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.28
LogP ≤ 5-3.81
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

2-[2-(2,5-dioxopyrrol-1-yl)ethyl-[2-(2-methylidenehydrazinyl)-2-oxoethyl]amino]-N-(methylideneamino)acetamide
CID 23557819
2-[2-[2-[Bis(2-hydrazinyl-2-oxoethyl)amino]ethyl-[2-(2,5-dioxopyrrol-1-yl)ethyl]amino]ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide
CID 23557820
2-[2-[2-[bis[2-(2-methylidenehydrazinyl)-2-oxoethyl]amino]ethyl-[2-(2,5-dioxopyrrol-1-yl)ethyl]amino]ethyl-[2-(2-methylidenehydrazinyl)-2-oxoethyl]amino]-N-(methylideneamino)acetamide
CID 23557821
2-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetohydrazide
CID 45089030
2-(2,5-Dioxopyrrol-1-yl)propanehydrazide
CID 66836198
4-[3-(4-Hydrazinyl-4-oxobut-2-enyl)-2,4-dioxoimidazolidin-1-yl]but-2-enehydrazide
CID 69094561
2-(2,5-Dioxopyrrol-1-yl)propanehydrazide;hydrochloride
CID 71431300
2-amino-N-[2-[[2-[2-(2,5-dioxopyrrol-1-yl)ethylamino]-2-oxoethyl]amino]-2-oxoethyl]acetamide
CID 90385948
N-[[2-[2-(2,5-dioxopyrrol-1-yl)ethyl-[2-[2-[hydroxy(methyl)boranyl]hydrazinyl]-2-oxoethyl]amino]acetyl]amino]-methylboronamidic acid
CID 91050897
2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide;2-[2-(2,5-dioxopyrrol-1-yl)ethyl-[2-(2-methylidenehydrazinyl)-2-oxoethyl]amino]-N-(methylideneamino)acetamide
CID 91272699
2-[2-[2-[bis(2-hydrazinyl-2-oxoethyl)amino]ethyl-[2-(2,5-dioxopyrrol-1-yl)ethyl]amino]ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide;2-[2-[2-[bis[2-(2-methylidenehydrazinyl)-2-oxoethyl]amino]ethyl-[2-(2,5-dioxopyrrol-1-yl)ethyl]amino]ethyl-[2-(2-methylidenehydrazinyl)-2-oxoethyl]amino]-N-(methylideneamino)acetamide
CID 91402831
1-[2-(2,2-Dimethylhydrazinyl)ethyl]pyrrole-2,5-dione
CID 123161946

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide?
The IUPAC name of 2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide (CID 23557818) is 2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide.
What is the SMILES notation for 2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide?
The canonical SMILES for 2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide is NNC(=O)CN(CCN1C(=O)C=CC1=O)CC(=O)NN.
What is the InChIKey of 2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide?
The InChIKey is RZEDTJVBKIPRPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N6O4/c11-13-7(17)5-15(6-8(18)14-12)3-4-16-9(19)1-2-10(16)20/h1-2H,3-6,11-12H2,(H,13,17)(H,14,18).
What are the key properties of 2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide?
2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide has a molecular weight of 284.28 g/mol, XLogP of -3.81, 7 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,5-dioxopyrrol-1-yl)ethyl-(2-hydrazinyl-2-oxoethyl)amino]acetohydrazide is sourced from PubChem (CID 23557818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).